4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide

C23H25N3O3 — CID 38371529

IUPAC4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide
SMILESNC(=O)c1ccc(CN(C(=O)Cc2ccc(N3CCCC3=O)cc2)C2CC2)cc1
InChIInChI=1S/C23H25N3O3/c24-23(29)18-7-3-17(4-8-18)15-26(20-11-12-20)22(28)14-16-5-9-19(10-6-16)25-13-1-2-21(25)27/h3-10,20H,1-2,11-15H2,(H2,24,29)
InChIKeyBFCGCAFTUWGZIR-UHFFFAOYSA-N
MW391.47 g/mol
LogP2.65
Rot. Bonds7

About 4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide

4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide (PubChem CID 38371529) has the molecular formula C23H25N3O3 and a molecular weight of 391.47 g/mol. Its IUPAC name is 4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide.

Molecular Properties

Compound Name4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide
PubChem CID38371529
Molecular FormulaC23H25N3O3
Molecular Weight391.47 g/mol
Exact Mass391.19
IUPAC Name4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide
SMILESNC(=O)c1ccc(CN(C(=O)Cc2ccc(N3CCCC3=O)cc2)C2CC2)cc1
InChIInChI=1S/C23H25N3O3/c24-23(29)18-7-3-17(4-8-18)15-26(20-11-12-20)22(28)14-16-5-9-19(10-6-16)25-13-1-2-21(25)27/h3-10,20H,1-2,11-15H2,(H2,24,29)
InChIKeyBFCGCAFTUWGZIR-UHFFFAOYSA-N
XLogP2.65
TPSA83.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-N-[(4-methoxyphenyl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 9299632
N-benzyl-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 27666071
N-cyclopropyl-N-[[4-(difluoromethoxy)-3-ethoxyphenyl]methyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 17480212
4-[[cyclopropyl-(2-naphthalen-1-ylacetyl)amino]methyl]benzamide
CID 38363437
4-[4-[[4-(2-oxopyrrolidin-1-yl)phenyl]methylcarbamoyl]phenoxy]benzamide
CID 56545380
1-[4-(2-oxopiperidin-1-yl)benzoyl]piperidine-4-carboxamide
CID 32978699
N-ethyl-N-(2-hydroxyethyl)-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 78821691
(2S)-2-methyl-3-[methyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]propanoic acid
CID 124689242
N-[(4-ethoxyphenyl)methyl]-N-methyl-4-(2-oxopyrrolidin-1-yl)benzamide
CID 27822823
N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 31847985
1-[4-(4-hydroxypiperidine-1-carbonyl)phenyl]piperidin-2-one
CID 110882060
4-(2-oxopyrrolidin-1-yl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide
CID 8589075

Frequently Asked Questions

What is the IUPAC name of 4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide?
The IUPAC name of 4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide (CID 38371529) is 4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide.
What is the SMILES notation for 4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide?
The canonical SMILES for 4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide is NC(=O)c1ccc(CN(C(=O)Cc2ccc(N3CCCC3=O)cc2)C2CC2)cc1.
What is the InChIKey of 4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide?
The InChIKey is BFCGCAFTUWGZIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O3/c24-23(29)18-7-3-17(4-8-18)15-26(20-11-12-20)22(28)14-16-5-9-19(10-6-16)25-13-1-2-21(25)27/h3-10,20H,1-2,11-15H2,(H2,24,29).
What are the key properties of 4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide?
4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide has a molecular weight of 391.47 g/mol, XLogP of 2.65, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[cyclopropyl-[2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetyl]amino]methyl]benzamide is sourced from PubChem (CID 38371529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).